4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine

C9H10N2S — CID 76850460

IUPAC4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)c1nccc2scnc12
InChIInChI=1S/C9H10N2S/c1-6(2)8-9-7(3-4-10-8)12-5-11-9/h3-6H,1-2H3
InChIKeyHSDIQXRBOJMBJB-UHFFFAOYSA-N
MW178.26 g/mol
LogP2.81
Rot. Bonds1

About 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine

4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 76850460) has the molecular formula C9H10N2S and a molecular weight of 178.26 g/mol. Its IUPAC name is 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
PubChem CID76850460
Molecular FormulaC9H10N2S
Molecular Weight178.26 g/mol
Exact Mass178.06
IUPAC Name4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)c1nccc2scnc12
InChIInChI=1S/C9H10N2S/c1-6(2)8-9-7(3-4-10-8)12-5-11-9/h3-6H,1-2H3
InChIKeyHSDIQXRBOJMBJB-UHFFFAOYSA-N
XLogP2.81
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(chloromethyl)-[1,3]thiazolo[4,5-c]pyridine
CID 119083740
8-propan-2-ylpyrido[2,3-d]pyridazine;4-propan-2-yl-[1,3]thiazolo[4,5-d]pyridazine
CID 161158714
4-phenyl-[1,3]thiazolo[4,5-c]pyridine
CID 140819940
4-(1-bromoethyl)thieno[3,2-c]pyridine
CID 70376593
1,8-di(propan-2-yl)-2,7-naphthyridine
CID 170669033
5-methyl-4-propan-2-yl-1,3-thiazole
CID 45121704
2-([1,3]thiazolo[4,5-c]pyridin-4-yl)acetic acid
CID 76850504
4-(3,5-dimethyl-1H-pyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridine
CID 163381238
5-(bromomethyl)-4-propan-2-yl-1,3-thiazole
CID 59589368
4-bromo-3-fluoro-2-propan-2-ylpyridine
CID 130153363
5-fluoro-4-propan-2-yl-1,3-thiazole
CID 138494786
2-methyl-7-propan-2-ylpyrazolo[3,4-c]pyridine
CID 146515408

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine (CID 76850460) is 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine is CC(C)c1nccc2scnc12.
What is the InChIKey of 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is HSDIQXRBOJMBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S/c1-6(2)8-9-7(3-4-10-8)12-5-11-9/h3-6H,1-2H3.
What are the key properties of 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 178.26 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 76850460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).